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(Z)-N-[(2-S,3-S,4-R)-2,3-ISOPROPYLIDENE-DIOXY-5-PHENYL-4-(N-TRIFLUOROACETYLBENZYLAMINE)-PENTYLIDENE]-BENZYLAMINE_N-OXIDE
SpectraBase Compound ID GyboMqOpkUS
InChI InChI=1S/C30H31F3N2O4/c1-29(2)38-26(21-34(37)19-23-14-8-4-9-15-23)27(39-29)25(18-22-12-6-3-7-13-22)35(28(36)30(31,32)33)20-24-16-10-5-11-17-24/h3-17,21,25-27H,18-20H2,1-2H3/b34-21+/t25-,26+,27-/m1/s1
InChIKey QXGLRVGZVWTCGC-WAUDIAJQSA-N
Mol Weight 540.58 g/mol
Molecular Formula C30H31F3N2O4
Exact Mass 540.223592 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C1hc4Lu8tGY
Name (Z)-N-[(2-S,3-S,4-R)-2,3-ISOPROPYLIDENE-DIOXY-5-PHENYL-4-(N-TRIFLUOROACETYLBENZYLAMINE)-PENTYLIDENE]-BENZYLAMINE_N-OXIDE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H31F3N2O4
InChI InChI=1S/C30H31F3N2O4/c1-29(2)38-26(21-34(37)19-23-14-8-4-9-15-23)27(39-29)25(18-22-12-6-3-7-13-22)35(28(36)30(31,32)33)20-24-16-10-5-11-17-24/h3-17,21,25-27H,18-20H2,1-2H3/b34-21+/t25-,26+,27-/m1/s1
InChIKey QXGLRVGZVWTCGC-WAUDIAJQSA-N
Literature Reference Author A.DONDONI,D.PERRONE,M.RINALDI
Literature Reference Citation J.ORG.CHEM.,63,9252(1998)
Literature Reference DOI 10.1021/jo980980u
Solvent DMSO-D6
Source File Reference UWMZ26099